DR2112 -OEChem-05042003293D 35 35 0 1 0 0 0 0 0999 V2000 1.8003 -2.2541 0.1263 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.1787 -0.9614 -0.4209 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3265 3.1380 -0.2785 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1473 -0.9411 -0.5487 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6335 1.6025 0.5218 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3166 -2.6261 0.0138 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7262 1.4973 -1.2716 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4074 -1.7095 1.5227 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1163 -2.4996 -0.7807 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8817 -3.4352 0.2433 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1823 1.7738 0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0127 1.1445 -0.2273 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2638 1.8217 0.2734 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5105 1.0444 -0.1551 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3640 -0.4416 0.1849 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0103 -0.3539 0.0824 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5358 -1.2704 -0.3318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4259 1.8865 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 2.5843 0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1357 1.3056 -1.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2521 1.9377 1.3642 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6677 1.1809 -1.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -0.5894 1.2714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0711 -0.5272 1.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6191 -1.2117 -1.4221 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4843 -0.9573 0.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0648 2.0813 1.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3488 3.0589 -1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 1.2401 0.1127 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4708 -2.8976 -0.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4065 2.5744 0.2746 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1077 3.6207 0.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4823 2.0712 1.7081 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8104 -2.3498 2.1469 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6514 -3.3081 -0.6315 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 1 10 2 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 13 1 0 0 0 0 3 28 1 0 0 0 0 4 16 1 0 0 0 0 5 14 1 0 0 0 0 5 29 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 7 18 2 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 M END $$$$